[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-cyanobenzoate

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-cyanobenzoate Openeye Name: [2-(4-methylanilino)thiazol-4-yl]methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-(4-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(p-toluidino)thiazol-4-yl]methyl ester Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H15N3O2S/c1-13-5-7-16(8-6-13)21-19-22-17(12-25-19)11-24-18(23)15-4-2-3-14(9-15)10-20/h2-9,12H,11H2,1H3,(H,21,22)